graphs-datasets/MD17-uracil download history

graphs-datasets/MD17-uracil is a graph ml dataset on the Hugging Face Hub. In the last 30 days it was downloaded 53 times (11 in the last 7 days), and 886 times in total. It ranks #177,952 among datasets by monthly downloads.

Dataset Card for uracil Dataset Summary The uracil dataset is a molecular dynamics (MD) dataset. The total energy and force labels for each dataset were computed using the PBE+vdW-TS electronic structure method. All geometries are in Angstrom, energies and forces are given in

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